SCHEMBL302358

SCHEMBL302358

C=CC(=O)OC(CCCCCCCCC)CCOc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.50
FAAH O00519 6/20 0.44
TDP1 Q9NUW8 1/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
ALOX5 P09917 1/20 0.44
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
LTA4H P09960 2/20 0.43
THRA P10827 1/20 0.43
PLA2G4B P0C869 1/20 0.43
S1PR1 P21453 1/20 0.42
S1PR3 Q99500 1/20 0.42
MLNR O43193 1/20 0.42
NR1I2 O75469 1/20 0.42
ESR1 P03372 1/20 0.42
NR3C1 P04150 1/20 0.42
PGR P06401 1/20 0.42
ADRB2 P07550 1/20 0.42
CHRM2 P08172 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL232072 0.89 THRB (0.45) THRBFAAHTDP1TSHRALOX5
SCHEMBL28858688 0.87 NPC1 (0.53) FAAHTP53TSHRPLA2G4B
SCHEMBL544768 0.86 THRB (0.56) THRBTDP1PPARGPPARA
SCHEMBL29269217 0.86 TP53 (0.65) TP53TSHRPLA2G4B
SCHEMBL17162489 0.84 PPARG (0.54) THRBTDP1ALOX5PPARGPPARA
Styrene SCHEMBL28549993 0.84 THRB (0.46) THRBTDP1THRA
SCHEMBL30337210 0.83 TP53 (0.61) TDP1TP53TSHRPLA2G4B
SCHEMBL1740777 0.83 FAAH (0.44) FAAHTDP1TP53TSHRALOX5
SCHEMBL30996363 0.82 KMT2A (0.53) THRBPPARGTHRAS1PR3NR1I2
SCHEMBL10784523 0.82 KMT2A (0.50) THRBPPARGTHRAS1PR3NR1I2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9339996-B2 Durable hydrophobic structured surface 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-05-17 US disclosed
EP-2590801-B1 DURABLE HYDROPHOBIC STRUCTURED SURFACE AND METHOD FOR PRODUCING SAID SURFACE 3M INNOVATIVE PROPERTIES CO (US) 2014-12-03 EP disclosed
US-8592514-B2 Urethane (meth) acrylate resin composition and coating material using the same DIC CORPORATION (JP) 2013-11-26 US disclosed
US-20130144000-A1 URETHANE (METH) ACRYLATE RESIN COMPOSITION AND COATING MATERIAL USING THE SAME DIC CORPORATION (JP) 2013-06-06 US disclosed
EP-2590801-A1 DURABLE HYDROPHOBIC STRUCTURED SURFACE 3M Innovative Properties Company (US) 2013-05-15 EP disclosed
US-20130101791-A1 DURABLE HYROPHOBIC STRUCTURED SURFACE 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-04-25 US disclosed
EP-2583987-A1 URETHANE (METH)ACRYLATE RESIN COMPOSITION AND COATING MATERIAL USING SAME DIC Corporation (JP) 2013-04-24 EP disclosed
US-20120289664-A1 POLYESTER (METH)ACRYLATE RESIN COMPOSITION, COATED STRUCTURE, AND METHOD FOR CONSTRUCTING THE SAME DIC CORPORATION (JP) 2012-11-15 US disclosed
US-8277944-B2 Primer composition, waterproof floor slab structure using the same, and method for waterproofing floor slab DIC CORPORATION (JP) 2012-10-02 US disclosed
EP-2497790-A1 POLYESTER (METH)ACRYLATE RESIN COMPOSITION, COATED STRUCTURE, AND METHOD FOR CONSTRUCTING SAME DIC Corporation (JP) 2012-09-12 EP disclosed
EP-1119586-B1 POLYFUNCTIONAL POLYMER 3M INNOVATIVE PROPERTIES CO (US) 2002-12-04 EP disclosed
US-6350823-B1 ETHYLENIC UNSATURATED POLYMER, POLYUREA, POLYURETHANEUREAS AND POLYTHIOCARBAMATEUREAS WITH POLYCARBONATES, POLYETHERS OR POLYESTERS AND ETHYLENE 3M INNOVATIVE PROPERTIES COMPANY 2002-02-26 US disclosed
US-20020022695-A1 Polymerizable unsaturated polyester resin composition DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-02-21 US disclosed
US-20020016421-A1 Pavement marking composition 3M INNOVATIVE PROPERTIES COMPANY 2002-02-07 US disclosed
EP-1149874-A1 Polymerizable unsaturated polyester resin composition DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-10-31 EP disclosed
EP-1119586-A1 POLYFUNCTIONAL POLYMER 3M Innovative Properties Company (US) 2001-08-01 EP disclosed
EP-1119587-A1 PAVEMENT MARKING COMPOSITION 3M Innovative Properties Company (US) 2001-08-01 EP disclosed
US-6107436-A POLYUREA/POLYURETHANE/POLYTHIOUREA COPOLYMERS HAVING POLYCARBONATE, POLYETHER AND/OR POLYESTER SEGMENTS, ISOCYANATE-REACTIVE UNSATURATED COMPOUND SEGMENTS, AND ASPARTIC ESTER-POLYAMINE DERIVATIVE CHAIN EXTENDER SEGMENTS 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-08-22 US disclosed
WO-2000020482-A1 POLYFUNCTIONAL POLYMER 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-04-13 WO disclosed
WO-2000020481-A1 PAVEMENT MARKING COMPOSITION 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-04-13 WO disclosed